6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine

Base Information

• Chemical Name: 6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine
• CAS No.: 917598-86-8
• Molecular Formula: C₄₉H₄₇N₁₁O₁₅P₂
• Molecular Weight: 1091.92
• Mol file: 917598-86-8.mol

Synonyms:

Chemical Property of 6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine

Chemical Property:

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of 6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine

There total 10 articles about 6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

Benzoic acid (2R,3S,4R)-4-(4-benzoylamino-2-oxo-2H-pyrimidin-1-yl)-2-[{(2R,3S,4R)-4-(6-benzoylamino-purin-9-yl)-2-[bis-(2-cyano-ethoxy)-phosphanyloxymethyl]-tetrahydro-furan-3-yloxy}-(2-cyano-ethoxy)-phosphoryloxymethyl]-tetrahydro-furan-3-yl ester → 6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine (917598-86-8)

Guidance literature:

With pyridine; iodine; In tetrahydrofuran; water; for 0.166667h;

DOI:10.1080/15257770500265703

Reference yield:

4-N-benzoyl-1'-deoxy-2'-isocytidine → 6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine (917598-86-8)

Guidance literature:

Multi-step reaction with 9 steps

1: pyridine

2: pyridine / 20 °C

3: CF₃CO₂H / CH₂Cl₂ / 20 °C

4: 1H-tetrazole / CH₂Cl₂ / 2 h

5: 1H-tetrazole / CH₂Cl₂ / 4 h

6: I₂; pyridine / H₂O; tetrahydrofuran / 0.17 h

7: 340 mg / dichloroacetic acid / CH₂Cl₂ / 0.33 h

8: 1H-tetrazole / CH₂Cl₂ / 4 h / 20 °C

9: 279 mg / I₂; pyridine / H₂O; tetrahydrofuran / 0.17 h

With pyridine; 1H-tetrazole; dichloro-acetic acid; iodine; trifluoroacetic acid; In tetrahydrofuran; dichloromethane; water;

DOI:10.1080/15257770500265703

Reference yield:

Benzoic acid (2R,3S,4R)-4-(4-benzoylamino-2-oxo-2H-pyrimidin-1-yl)-2-[bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-tetrahydro-furan-3-yl ester → 6-N-benzoyl-5'-O-[di(2-cyanoethoxy)phosphinyl]-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine (917598-86-8)

Guidance literature:

Multi-step reaction with 7 steps

1: CF₃CO₂H / CH₂Cl₂ / 20 °C

2: 1H-tetrazole / CH₂Cl₂ / 2 h

3: 1H-tetrazole / CH₂Cl₂ / 4 h

4: I₂; pyridine / H₂O; tetrahydrofuran / 0.17 h

5: 340 mg / dichloroacetic acid / CH₂Cl₂ / 0.33 h

6: 1H-tetrazole / CH₂Cl₂ / 4 h / 20 °C

7: 279 mg / I₂; pyridine / H₂O; tetrahydrofuran / 0.17 h

With pyridine; 1H-tetrazole; dichloro-acetic acid; iodine; trifluoroacetic acid; In tetrahydrofuran; dichloromethane; water;

DOI:10.1080/15257770500265703

upstream raw materials:

6-N-benzoyl-P-(2-cyanoethyl)-1'-deoxy-2'-isoadenylyl-(3'->5')-4-N,3'-O-dibenzoyl-1'-deoxy-2'-isocytidine

bis(2-cyanoethyl) diisopropylamidophosphite

N-(9-{(3R,4S,5R)-5-[Bis-(4-methoxy-phenyl)-phenyl-methoxymethyl]-4-hydroxy-tetrahydro-furan-3-yl}-9H-purin-6-yl)-benzamide

4-N-benzoyl-1'-deoxy-2'-isocytidine